VPO4

VPO4 is a stable, semiconducting transition-metal phosphate used as a model material in solid-state research.

Crystal structure of VPO4
Ground-state structure · Materials Project
Overview

About VPO4

VPO4 is a transition-metal phosphate that exists as a thermodynamically stable phase on the convex hull. As a semiconducting material, it represents a significant subject of study within inorganic chemistry, characterized by a robust structural framework that supports diverse atomic configurations.

Its importance lies in its chemical flexibility and the stability of its lattice, which makes it a compelling candidate for electrochemical applications. With numerous reported structures across databases, it serves as a foundational material for understanding redox-active phosphate frameworks in solid-state science.

At a glance

Key Properties

Cross-validated computational properties for VPO4, aggregated across 4 databases.

Band Gap

0.98–2.11 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

16
4 databases, 6 space groups
Uses

Applications

Where VPO4 is used.

Electrochemical energy storage researchSolid-state ionicsCatalysis research
Reference

Frequently Asked Questions

Common questions about VPO4, answered from cross-validated data.

What is VPO4?

VPO4 is a stable, semiconducting transition-metal phosphate used as a model material in solid-state research.

More questions
What is VPO4 used for?
VPO4 is used in electrochemical energy storage research, solid-state ionics, and catalysis research.
What is the band gap of VPO4?
VPO4 has a DFT-computed band gap of 0.98–2.11 eV across 16 reported structures.
Is VPO4 a metal, semiconductor, or insulator?
With a band gap up to 2.11 eV it is a semiconductor.
Is VPO4 thermodynamically stable?
Yes — VPO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of VPO4 are known?
16 structures of VPO4 are reported across 4 databases, spanning 6 distinct space groups.
What elements does VPO4 contain?
VPO4 contains O, P, and V (3 elements).
Where does the data for VPO4 come from?
VPO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the transition-metal phosphates class.

Within the broad class of transition-metal phosphates, VPO4 occupies a distinct position compared to well-known battery cathode materials like LiFePO4 or LiMnPO4. While its siblings are frequently utilized for their specific lithium-ion intercalation properties, VPO4 serves as a critical structural analog that helps researchers map the stability and electronic evolution of vanadium-based phosphate systems against iron or cobalt counterparts.

Explore

Related Compounds

Other Transition-Metal Phosphates in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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